SCHEMBL6365174

SCHEMBL6365174

C=CCOc1ccccc1C(=O)NCCN(CC)CC

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LIG1 P18858 1/20 0.60
▸ ALDH1A1 P00352 5/20 0.57
▸ KDM4E B2RXH2 3/20 0.57
▸ HPGD P15428 1/20 0.57
▸ HCRTR1 O43613 2/20 0.56
▸ MCHR1 Q99705 5/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ TSHR P16473 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ SLC22A2 O15244 1/20 0.47
▸ SLC22A1 O15245 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Alloclamide SCHEMBL872157 0.84 MCHR1 (0.53) ALDH1A1KDM4EHPGDMCHR1SMN1; SMN2
Alloclamide SCHEMBL29730070 0.84 MCHR1 (0.53) ALDH1A1KDM4EHPGDMCHR1SMN1; SMN2
Alloclamide SCHEMBL209095 0.83 MCHR1 (0.52) ALDH1A1KDM4EHPGDMCHR1SMN1; SMN2
Alloclamide SCHEMBL27527103 0.82 MCHR1 (0.51) ALDH1A1KDM4EHPGDMCHR1SMN1; SMN2
Flualamide SCHEMBL2734613 0.81 MCHR1 (0.58) ALDH1A1MCHR1TSHRLMNASLC22A2
Flualamide SCHEMBL29804765 0.81 MCHR1 (0.58) ALDH1A1MCHR1TSHRLMNASLC22A2
SCHEMBL11783506 0.81 KDM4E (0.57) ALDH1A1KDM4EHPGDHCRTR1MCHR1
SCHEMBL11619021 0.80 LMNA (0.47) ALDH1A1KDM4EHPGDMCHR1SMN1; SMN2
SCHEMBL10656342 0.77 ADRA2A (0.49) ALDH1A1KDM4EHPGDMCHR1SMN1; SMN2
SCHEMBL28696012 0.76 LIG1 (0.77) LIG1ALDH1A1KDM4EHPGDHCRTR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050260238-A1 Cosmetic compositions comprising wholly hydrophilic block copolymers and particular anti-fungal agents L'OREAL (FR) 2005-11-24 — — US disclosed
EP-1595525-A1 Composition containing a combination of a block copolymer exclusively based on hydrophile blocks and a particular antifungicide L'OREAL (FR) 2005-11-16 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050260238-A1 Cosmetic compositions comprising wholly hydrophilic block copolymers and particular anti-fungal agents SCLY, SUCLG1, POLR1C LIG1 1594/4885ALDH1A1 1032/4885KDM4E 1764/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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